3,4,5-trimethoxy-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride

Systemtic Name: 3,4,5-trimethoxy-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride Openeye Name: 3,4,5-trimethoxy-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride CAS Name: 3,4,5-trimethoxy-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride IUPAC Name: 3,4,5-trimethoxy-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride Traditional Name: 3,4,5-trimethoxy-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)benzamide hydrochloride Formula: C12H14ClN3O4S2 MolecularWeight: 363.84026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NNC(=S)S2.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NNC(=S)S2.Cl

InChI

InChI=1S/C12H13N3O4S2.ClH/c1-17-7-4-6(5-8(18-2)9(7)19-3)10(16)13-11-14-15-12(20)21-11;/h4-5H,1-3H3,(H,15,20)(H,13,14,16);1H